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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesterterpenoid > scalarane sesterterpenoid > 12-epi-scalaradial
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesterterpenoid > scalarane sesterterpenoid > 12-epi-scalaradial

Preferred term

12-epi-scalaradial  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C27H40O4

inchi

  • InChI=1S/C27H40O4/c1-17(30)31-23-14-22-25(4)12-7-11-24(2,3)20(25)10-13-26(22,5)21-9-8-18(15-28)19(16-29)27(21,23)6/h8,15-16,19-23H,7,9-14H2,1-6H3/t19-,20-,21-,22+,23+,25-,26-,27+/m0/s1

inchikey

  • ADWFEADZGIHPDE-VYGQJASISA-N

mass

  • 428.605

monoisotopicmass

  • 428.293

smiles

  • O=C(O[C@H]1[C@@]2([C@H](C(=CC[C@H]2[C@@]3(CC[C@@H]4[C@@]([C@H]3C1)(CCCC4(C)C)C)C)C=O)C=O)C)C

subset

  • 2_STAR

synonym EXACT

  • [(4aS,4bR,6R,6aS,7R,10aS,10bR,12aS)-7,8-diormyl-1,1,4a,6a,10b-pentamethyl-2,3,4,4b,5,6,7,10,10a,11,12,12a-dodecahydrochrysen-6-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:144414

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